CID 3044119

Benzenebutanamine, delta-phenyl-n,n,alpha,alpha-tetramethyl-, hydrochloride

Structural Information

Molecular Formula
C20H27N
SMILES
CC(C)(CCC(C1=CC=CC=C1)C2=CC=CC=C2)N(C)C
InChI
InChI=1S/C20H27N/c1-20(2,21(3)4)16-15-19(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,19H,15-16H2,1-4H3
InChIKey
ZDOCGTBQUPBJJQ-UHFFFAOYSA-N
Compound name
N,N,2-trimethyl-5,5-diphenylpentan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.21436 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.22164 171.0
[M+Na]+ 304.20358 174.5
[M-H]- 280.20708 178.0
[M+NH4]+ 299.24818 186.8
[M+K]+ 320.17752 171.4
[M+H-H2O]+ 264.21162 162.7
[M+HCOO]- 326.21256 192.3
[M+CH3COO]- 340.22821 209.6
[M+Na-2H]- 302.18903 174.9
[M]+ 281.21381 171.7
[M]- 281.21491 171.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.